SCHEMBL6039893

SCHEMBL6039893

CC(C)(C)OC(=O)C(=O)N1CCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
CTSK P43235 1/20 0.41
PREP P48147 2/20 0.38
EPHX1 P07099 1/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 3/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.33
RECQL P46063 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6039784 0.96 HPGD (0.46) HPGDSMN1; SMN2USP2MEN1KMT2A
SCHEMBL13533886 0.83 USP2 (0.56) HPGDSMN1; SMN2USP2MEN1KMT2A
SCHEMBL2264197 0.82 CA2 (0.41) HPGDSMN1; SMN2USP2CA1CA2
SCHEMBL4081702 0.81 HPGD (0.41) HPGDSMN1; SMN2USP2MEN1KMT2A
SCHEMBL861278 0.77 USP2 (0.64) HPGDSMN1; SMN2USP2MEN1KMT2A
SCHEMBL15050742 0.76 ALDH1A1 (0.48) HPGDSMN1; SMN2MEN1KMT2AEPHX1
Iodide SCHEMBL15174787 0.76 USP2 (0.62) HPGDSMN1; SMN2USP2MEN1KMT2A
SCHEMBL16612394 0.76 USP2 (0.62) HPGDSMN1; SMN2USP2MEN1KMT2A
SCHEMBL9353116 0.75 GAA (0.42) HPGDSMN1; SMN2KMT2AMAPTALDH1A1
SCHEMBL7416322 0.74 USP2 (0.55) HPGDSMN1; SMN2USP2MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006038001-A1 AMINOPYRIMIDINE DERIVATIVES AS JNK INHIBITORS CELLTECH R & D LIMITED (GB) 2006-04-13 WO disclosed